(E)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-phenylsulfanyl-prop-2-enamide

Systemtic Name: (E)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-phenylsulfanyl-prop-2-enamide Openeye Name: (E)-3-phenylsulfanyl-N-quinuclidin-3-yl-prop-2-enamide CAS Name: (E)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-(phenylthio)-2-propenamide IUPAC Name: (E)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-phenylsulfanylprop-2-enamide Traditional Name: (E)-3-(phenylthio)-N-quinuclidin-3-yl-acrylamide Formula: C16H20N2OS MolecularWeight: 288.4078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C=CSC3=CC=CC=C3

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)/C=C/SC3=CC=CC=C3

InChI

InChI=1S/C16H20N2OS/c19-16(8-11-20-14-4-2-1-3-5-14)17-15-12-18-9-6-13(15)7-10-18/h1-5,8,11,13,15H,6-7,9-10,12H2,(H,17,19)/b11-8+